Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50477749'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase (Homo sapiens (Human))	BDBM50477749 (CHEMBL249580) Show SMILES ONC(=O)CCC1=CCCN(CCc2ccc(cc2)-c2ccccc2)C1=O |t:6| Show InChI InChI=1S/C22H24N2O3/c25-21(23-27)13-12-20-7-4-15-24(22(20)26)16-14-17-8-10-19(11-9-17)18-5-2-1-3-6-18/h1-3,5-11,27H,4,12-16H2,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Bioscience and Biotechnology Curated by ChEMBL					Assay Description Inhibition of HDAC in HeLa cell lysates				Bioorg Med Chem Lett 17: 6234-8 (2007) Article DOI: 10.1016/j.bmcl.2007.09.034 BindingDB Entry DOI: 10.7270/Q2RN3BMB
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